2-[3-methylsulfonyl-1-(phenylmethyl)indol-2-yl]sulfanylethanamine

Systemtic Name: 2-[3-methylsulfonyl-1-(phenylmethyl)indol-2-yl]sulfanylethanamine Openeye Name: 2-(1-benzyl-3-methylsulfonyl-indol-2-yl)sulfanylethanamine CAS Name: 2-[[3-methylsulfonyl-1-(phenylmethyl)-2-indolyl]thio]ethanamine IUPAC Name: 2-(1-benzyl-3-methylsulfonylindol-2-yl)sulfanylethanamine Traditional Name: 2-[(1-benzyl-3-mesyl-indol-2-yl)thio]ethylamine Formula: C18H20N2O2S2 MolecularWeight: 360.4936

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3)SCCN

Isomeric SMILES

CS(=O)(=O)C1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3)SCCN

InChI

InChI=1S/C18H20N2O2S2/c1-24(21,22)17-15-9-5-6-10-16(15)20(18(17)23-12-11-19)13-14-7-3-2-4-8-14/h2-10H,11-13,19H2,1H3